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enviGCMS (version 0.8.0)

getmdh: Get the high order unit based Mass Defect

Description

Get the high order unit based Mass Defect

Usage

getmdh(mz, cus = c("CH2,H2"), method = "round")

Value

high order Mass Defect with details

Arguments

mz

numeric vector for exact mass

cus

chemical formula or reaction

method

you could use `round`, `floor` or `ceiling`